UCSF

ZINC14961335

Substance Information

In ZINC since Heavy atoms Benign functionality
July 18th, 2008 13 No

Download: MOL2 SDF SMILES Flexibase

Annotations

Vendors

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) -2.06 -7.18 -10.03 5 6 0 118 194.183 5
Hi High (pH 8-9.5) -2.92 -5.81 -56.06 4 6 -1 121 193.175 5
Hi High (pH 8-9.5) -2.92 -6.76 -56.58 4 6 -1 121 193.175 5
Hi High (pH 8-9.5) -2.92 -7.51 -56.97 4 6 -1 121 193.175 5

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Analogs ( Draw Identity 99% 90% 80% 70% )

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